ChemSpider 2D Image | 5-Acetamido-N-[4'-amino-4-(4-methyl-1-piperazinyl)-3-biphenylyl]-2-chloro-4-fluoro-3-methylbenzamide | C27H29ClFN5O2

5-Acetamido-N-[4'-amino-4-(4-methyl-1-piperazinyl)-3-biphenylyl]-2-chloro-4-fluoro-3-methylbenzamide

  • Molecular FormulaC27H29ClFN5O2
  • Average mass510.003 Da
  • Monoisotopic mass509.199371 Da
  • ChemSpider ID76810160

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

5-Acetamido-N-[4'-amino-4-(4-methyl-1-piperazinyl)-3-biphenylyl]-2-chlor-4-fluor-3-methylbenzamid [German] [ACD/IUPAC Name]
5-Acetamido-N-[4'-amino-4-(4-methyl-1-piperazinyl)-3-biphenylyl]-2-chloro-4-fluoro-3-methylbenzamide [ACD/IUPAC Name]
5-Acétamido-N-[4'-amino-4-(4-méthyl-1-pipérazinyl)-3-biphénylyl]-2-chloro-4-fluoro-3-méthylbenzamide [French] [ACD/IUPAC Name]
Benzamide, 5-(acetylamino)-N-[4'-amino-4-(4-methyl-1-piperazinyl)[1,1'-biphenyl]-3-yl]-2-chloro-4-fluoro-3-methyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 663.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.5±3.0 kJ/mol
Flash Point: 354.8±31.5 °C
Index of Refraction: 1.661
Molar Refractivity: 142.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 4.14
ACD/KOC (pH 5.5): 31.13
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 133.62
ACD/KOC (pH 7.4): 1005.33
Polar Surface Area: 91 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 384.7±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement